SCHEMBL21183292

SCHEMBL21183292

CC(C)(C)OC(=O)NCCNc1nc2[nH]cnc2c(=O)[nH]1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ BCHE P06276 1/20 0.55
▸ MALT1 Q9UDY8 1/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ STK17B O94768 1/20 0.39
▸ STK17A Q9UEE5 1/20 0.39
▸ NPSR1 Q6W5P4 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ XDH P47989 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ LATS1 O95835 1/20 0.37
▸ CACNA1H O95180 1/20 0.37
▸ CACNA1B Q00975 1/20 0.37
▸ CACNA1C Q13936 1/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ MAPT P10636 2/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL609127 0.93 BCHE (0.47) BCHEL3MBTL1STK17BSTK17ANPSR1
SCHEMBL610056 0.91 BCHE (0.46) BCHEL3MBTL1STK17BSTK17ANPSR1
SCHEMBL10047095 0.90 BCHE (0.42) BCHEL3MBTL1STK17BSTK17ANPSR1
SCHEMBL10073542 0.89 BCHE (0.44) BCHEL3MBTL1STK17BSTK17ANPSR1
SCHEMBL28469810 0.83 GDA (0.42) BCHEL3MBTL1TDP1MEN1KMT2A
SCHEMBL10073929 0.81 CCNE2 (0.38) BCHEL3MBTL1NPSR1TDP1ATM
SCHEMBL13976379 0.77 BCHE (0.44) BCHEMALT1L3MBTL1STK17BSTK17A
SCHEMBL766670 0.75 XDH (0.41) XDHKMT2A
SCHEMBL21258890 0.75 XDH (0.41) XDHPOLB
SCHEMBL18176950 0.75 BCHE (0.44) BCHEMALT1L3MBTL1STK17BSTK17A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3783105-B1 SECRETORY IMMUNOGLOBULIN A (SIGA)-BINDING NUCLEIC ACID MOLECULE, SENSOR FOR SIGA ANALYSIS, AND ANALYSIS METHOD FOR SIGA NEC SOLUTION INNOVATORS LTD (JP) 2021-11-03 — — EP disclosed
EP-3514237-B1 SECRETORY IMMUNOGLOBULIN A (SIGA)-BINDING NUCLEIC ACID MOLECULE, SENSOR FOR SIGA ANALYSIS, AND ANALYSIS METHOD FOR SIGA NEC SOLUTION INNOVATORS LTD (JP) 2021-07-14 — — EP disclosed
EP-3783105-A1 SECRETORY IMMUNOGLOBULIN A (SIGA)-BINDING NUCLEIC ACID MOLECULE, SENSOR FOR SIGA ANALYSIS, AND ANALYSIS METHOD FOR SIGA NEC Solution Innovators, Ltd. (JP) 2021-02-24 — — EP disclosed
EP-3514237-A1 SECRETORY IMMUNOGLOBULIN A (SIGA)-BINDING NUCLEIC ACID MOLECULE, SENSOR FOR SIGA ANALYSIS, AND ANALYSIS METHOD FOR SIGA NEC Solution Innovators, Ltd. (JP) 2019-07-24 — — EP disclosed
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